AB-INITIO CALCULATION OF VIBRATIONAL CIRCULAR-DICHROISM SPECTRA OF CHIRAL NATURAL-PRODUCTS USING MP2 FORCE-FIELDS - CAMPHOR

被引:24
作者
DEVLIN, FJ [1 ]
STEPHENS, PJ [1 ]
机构
[1] UNIV SO CALIF,DEPT CHEM,LOS ANGELES,CA 90089
关键词
D O I
10.1021/ja00090a062
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
[No abstract available]
引用
收藏
页码:5003 / 5004
页数:2
相关论文
共 32 条
[1]   X-RAY STUDIES OF TERPENOIDS .3. REDETERMINATION OF CRYSTAL STRUCTURE OF (+)-3-BROMOCAMPHOR - ABSOLUTE CONFIGURATION OF (+)-CAMPHOR [J].
ALLEN, FH ;
ROGERS, D .
JOURNAL OF THE CHEMICAL SOCIETY B-PHYSICAL ORGANIC, 1971, (04) :632-&
[2]   VIBRATIONAL PROPERTIES OF (R)-METHYLTHIIRANE FROM MOLLER-PLESSET PERTURBATION-THEORY [J].
AMOS, RD ;
HANDY, NC ;
PALMIERI, P .
JOURNAL OF CHEMICAL PHYSICS, 1990, 93 (08) :5796-5804
[3]   ALTERNATIVE FORMALISM FOR THE CALCULATION OF ATOMIC POLAR TENSORS AND ATOMIC AXIAL TENSORS [J].
AMOS, RD ;
JALKANEN, KJ ;
STEPHENS, PJ .
JOURNAL OF PHYSICAL CHEMISTRY, 1988, 92 (20) :5571-5575
[4]   EFFICIENT CALCULATION OF VIBRATIONAL MAGNETIC DIPOLE TRANSITION MOMENTS AND ROTATIONAL STRENGTHS [J].
AMOS, RD ;
HANDY, NC ;
JALKANEN, KJ ;
STEPHENS, PJ .
CHEMICAL PHYSICS LETTERS, 1987, 133 (01) :21-26
[5]  
AMOS RD, 1992, CADPAC 5 0
[6]  
BURSI R, 1991, THESIS U SO CALIFORN
[7]  
CHABALOWSKI CF, UNPUB
[8]  
Fogarasi G., 1985, Vibrational spectra and structure. A Series of Advances. Vol.14, P125
[9]  
Forgarasi G., 1984, ANNU REV PHYS CHEM, V35, P191
[10]  
FRISCH M, 1992, GAUSSIAN 92 USERS GU